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2060000-26-0 | 2-{imidazo[1,2-a]pyrimidin-2-yl}-1H-imidazole
CAS No: 2060000-26-0 Catalog No: AG01B6I7 MDL No:MFCD30344922
Product Description
Catalog Number:
AG01B6I7
Chemical Name:
2-{imidazo[1,2-a]pyrimidin-2-yl}-1H-imidazole
CAS Number:
2060000-26-0
Molecular Formula:
C9H7N5
Molecular Weight:
185.1854
MDL Number:
MFCD30344922
IUPAC Name:
2-(1H-imidazol-2-yl)imidazo[1,2-a]pyrimidine
InChI:
InChI=1S/C9H7N5/c1-2-12-9-13-7(6-14(9)5-1)8-10-3-4-11-8/h1-6H,(H,10,11)
InChI Key:
HTPDTLAOQOHROM-UHFFFAOYSA-N
SMILES:
c1c[nH]c(n1)c1nc2n(c1)cccn2
Properties
Complexity:
209
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
185.07g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
185.19g/mol
Monoisotopic Mass:
185.07g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
58.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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